Vitas-M small molecule compound
propan-2-yl ({(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetate
Catalog ID
STK992926
SMILES CC(OC(=O)COc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H19ClO7 MW 430.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClO7/c1-12(2)29-20(24)10-27-16-3-4-17-18(8-16)30-19(21(17)25)7-13-5-15(23)6-14-9-26-11-28-22(13)14/h3-8,12H,9-11H2,1-2H3/b19-7-InChIKey
IVYXEZKQXXMJBI-GXHLCREISA-NSynonyms
929477-35-0(Z)isopropyl2((2((6chloro4Hbenzo(d)(13)dioxin8yl)methylene)3oxo23dihydrobenzofuran6yl)oxy)acetate
929477350
CC(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC4=C3OCOC4)Cl)O2
CC(OC(=O)COc1ccc2c(c1)OC(=Cc1cc(Cl)cc3c1OCOC3)C2=O)C
InChI=1SC22H19ClO7c112(2)2920(24)102716341718(816)3019(21(17)25)713515(23)614926112822(13)14h3812H911H212H3b197
METHYLETHYL2(2((6CHLORO(2H4HBENZO(E)13DIOXIN8YL))METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETATE
MFCD09847646
propan2yl(((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo23dihydro1benzofuran6yl)oxy)acetate
propan2yl2(((2Z)2((6chloro4H13benzodioxin8yl)methylidene)3oxo1benzofuran6yl)oxy)acetate
ZINC000013656476
ZINC13656476
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